2-[2-(4-chlorophenyl)sulfanylethyliminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylethyliminomethyl]-4-nitro-phenolate Openeye Name: 2-[2-(4-chlorophenyl)sulfanylethyliminomethyl]-4-nitro-phenolate CAS Name: 2-[2-[(4-chlorophenyl)thio]ethyliminomethyl]-4-nitrophenolate IUPAC Name: 2-[2-(4-chlorophenyl)sulfanylethyliminomethyl]-4-nitrophenolate Traditional Name: 2-[2-[(4-chlorophenyl)thio]ethyliminomethyl]-4-nitro-phenolate Formula: C15H12ClN2O3S- MolecularWeight: 335.78538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1SCCN=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])Cl

InChI

InChI=1S/C15H13ClN2O3S/c16-12-1-4-14(5-2-12)22-8-7-17-10-11-9-13(18(20)21)3-6-15(11)19/h1-6,9-10,19H,7-8H2/p-1